N,N-diethyl-beta-alanine hydrochloride
TL;DR: N,N-diethyl-beta-alanine hydrochloride (CAS 15674-67-6) is a chemical compound with molecular formula C7H16ClNO2 and molecular weight 181.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylamino)propanoic acid;hydrochloride
Also Known As: 3-(diethylamino)propanoic acid hydrochloride, N,N-Diethyl-beta-alanine hydrochloride, 3-(Diethylamino)propionic acid hydrochloride, N,N-Diethyl-beta-alanine, beta-Alanine, N,N-diethyl-
| Molecular Formula | C7H16ClNO2 |
|---|---|
| Molecular Weight | 181.09 g/mol |
| LogP | 1.2247 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 181.08696 |
| Heavy Atoms | 11 |
| Complexity | 104.61369 |
Chemical Identifiers
| CAS Number | 15674-67-6 |
|---|---|
| SMILES | CCN(CC)CCC(=O)O.Cl |
Product Overview
N,N-diethyl-beta-alanine hydrochloride (CAS 15674-67-6), with molecular formula C7H16ClNO2 and molecular weight 181.09 g/mol. IUPAC: 3-(diethylamino)propanoic acid;hydrochloride.
Chemical Property Profile of N,N-diethyl-beta-alanine hydrochloride
Property Insights of N,N-diethyl-beta-alanine hydrochloride
The XLogP value of 1.2247 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethyl-beta-alanine hydrochloride. With a topological polar surface area (TPSA) of 40.54 Ų, N,N-diethyl-beta-alanine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-beta-alanine hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N,N-diethyl-beta-alanine hydrochloride?
The CAS number of N,N-diethyl-beta-alanine hydrochloride is 15674-67-6.
What is the molecular formula of N,N-diethyl-beta-alanine hydrochloride?
The molecular formula of N,N-diethyl-beta-alanine hydrochloride is C7H16ClNO2.
What is the molecular weight of N,N-diethyl-beta-alanine hydrochloride?
The molecular weight of N,N-diethyl-beta-alanine hydrochloride is 181.09 g/mol.
Where can I buy N,N-diethyl-beta-alanine hydrochloride?
You can request a quote for N,N-diethyl-beta-alanine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-beta-alanine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-beta-alanine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.